trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane

C26H27F3N2OSi — CID 22352448

IUPACtrimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1nc(-c2ccccc2)c2cc(-c3ccccc3C(F)(F)F)ccc21
InChIInChI=1S/C26H27F3N2OSi/c1-33(2,3)16-15-32-18-31-24-14-13-20(21-11-7-8-12-23(21)26(27,28)29)17-22(24)25(30-31)19-9-5-4-6-10-19/h4-14,17H,15-16,18H2,1-3H3
InChIKeyBPXPDJAEURWEKS-UHFFFAOYSA-N
MW468.60 g/mol
LogP7.70
Rot. Bonds7

About trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane

trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane (PubChem CID 22352448) has the molecular formula C26H27F3N2OSi and a molecular weight of 468.60 g/mol. Its IUPAC name is trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane
PubChem CID22352448
Molecular FormulaC26H27F3N2OSi
Molecular Weight468.60 g/mol
Exact Mass468.18
IUPAC Nametrimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1nc(-c2ccccc2)c2cc(-c3ccccc3C(F)(F)F)ccc21
InChIInChI=1S/C26H27F3N2OSi/c1-33(2,3)16-15-32-18-31-24-14-13-20(21-11-7-8-12-23(21)26(27,28)29)17-22(24)25(30-31)19-9-5-4-6-10-19/h4-14,17H,15-16,18H2,1-3H3
InChIKeyBPXPDJAEURWEKS-UHFFFAOYSA-N
XLogP7.70
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.60
LogP ≤ 57.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane (CID 22352448) is trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane is C[Si](C)(C)CCOCn1nc(-c2ccccc2)c2cc(-c3ccccc3C(F)(F)F)ccc21.
What is the InChIKey of trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane?
The InChIKey is BPXPDJAEURWEKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27F3N2OSi/c1-33(2,3)16-15-32-18-31-24-14-13-20(21-11-7-8-12-23(21)26(27,28)29)17-22(24)25(30-31)19-9-5-4-6-10-19/h4-14,17H,15-16,18H2,1-3H3.
What are the key properties of trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane?
trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane has a molecular weight of 468.60 g/mol, XLogP of 7.70, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[3-phenyl-5-[2-(trifluoromethyl)phenyl]indazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 22352448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).